SCHEMBL129649

SCHEMBL129649

Cc1cccc2cc[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.56
KEAP1 Q14145 1/20 0.48
AR P10275 2/20 0.47
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
NR3C2 P08235 1/20 0.47
PDPK1 O15530 1/20 0.47
BRD4 O60885 2/20 0.44
TAF1 P21675 1/20 0.44
BRPF1 P55201 1/20 0.44
CREBBP Q92793 1/20 0.44
CECR2 Q9BXF3 1/20 0.44
BRD9 Q9H8M2 1/20 0.44
BCHE P06276 3/20 0.43
REN P00797 1/20 0.43
TRPA1 O75762 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
ITGB2 P05107 1/20 0.41
ICAM1 P05362 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29364263 1.00 AHR (0.56) AHRKEAP1ARNR3C1PGR
Methane SCHEMBL27911669 0.98 AHR (0.54) AHRKEAP1ARNR3C1PGR
Formic Acid SCHEMBL29178525 0.88 KEAP1 (0.49) AHRKEAP1ARNR3C1PGR
Acetic Acid SCHEMBL9117969 0.88 KEAP1 (0.58) AHRKEAP1ARNR3C1PGR
Pyridine SCHEMBL28517156 0.87 AHR (0.44) AHRKEAP1ARNR3C1PGR
SCHEMBL10463767 0.83 AHR (0.48) AHRKEAP1ARNR3C1PGR
SCHEMBL4173132 0.83 REN (0.49) AHRKEAP1ARNR3C1PGR
SCHEMBL8186590 0.82 CYP2A6 (0.44) AHRKEAP1ARNR3C1PGR
Tert-Butyl Formate SCHEMBL27584058 0.81 NR3C1 (0.42) AHRKEAP1ARNR3C1PGR
Ethyl Isothiocyanate SCHEMBL2728336 0.80 REN (0.39) AHRKEAP1ARNR3C1PGR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1708 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117886736-B 2-Indolyl-3-imine indoline derivative, preparation method and application thereof Suzhou Highfine Biotech Co.,Ltd. (CN) 2026-05-26 CN claimed
US-20250075147-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS OSMO LABS, PBC 2025-03-06 US claimed
CN-119307565-A Method for synthesizing L-7-methyl tryptophan by enzyme method 浙江普洛生物科技有限公司 2025-01-14 CN claimed
CN-118546083-B Method and system for synthesizing indole and derivative thereof by alcohol amine method 陕西氢易能源科技有限公司 2024-12-03 CN claimed
CN-118979261-A Electrolyte and application thereof in organic liquid hydrogen storage 陕西氢易能源科技有限公司 2024-11-19 CN claimed
CN-118976485-A Catalyst for electrochemical hydrogenation of aromatic compounds and preparation method thereof 陕西氢易能源科技有限公司 2024-11-19 CN claimed
CN-118530155-B Method for preparing 7-methylindole under normal temperature condition 山东仁一生物科技有限责任公司 2024-09-27 CN claimed
CN-118546083-A Method and system for synthesizing indole and derivative thereof by alcohol amine method 陕西氢易能源科技有限公司 2024-08-27 CN claimed
CN-118530155-A Method for preparing 7-methylindole under normal temperature condition 山东仁一生物科技有限责任公司 2024-08-23 CN claimed
CN-117886736-A 2-indolyl-3-imine indoline derivative, preparation method and application thereof 苏州昊帆生物股份有限公司 2024-04-16 CN claimed
WO-2004093518-A2 IMMUNOSTIMULATORY AGENTS IN BOTANICALS THE UNIVERSITY OF MISSISSIPPI (US) 2004-11-04 WO claimed
US-20040159264-A1 Composition and method for preparing chemically-resistant roughened copper surfaces for bonding to substrates MACDERMID, INCORPORATED 2004-08-19 US claimed
WO-2004069196-A2 NOVEL COMPOUNDS REPLIDYNE, INC. (US) 2004-08-19 WO claimed
US-6716281-B2 ADHESION PROMOTER COMPREISING OXIDIZER, PH ADJUSTER, TOPOGRAPHY MODIFIER; AND COATING STABILIZER COMPRISING 2-MERCAPTOTHIAZOLINE OR 2-MERCAPTOIMIDAZOLINE DERIVATIVE ELECTROCHEMICALS, INC. 2004-04-06 US claimed
US-20030213553-A1 Composition and method for preparing chemically-resistant roughened copper surfaces for bonding to substrates MACDERMID, INCORPORATED 2003-11-20 US claimed
CN-1451031-A Method for roughening copper surfaces for bonding to substrates ELECTROCHEMICALS INC (US) 2003-10-22 CN claimed
JP-2003519286-A 2003-06-17 JP claimed
EP-1255797-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2002-11-13 EP claimed
WO-2001049805-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2001-07-12 WO claimed
EP-0553054-A2 A process for the examination of individual items for the contents of a fat-soluble compound Slagteriernes Forskningsinstitut (DK) 1993-07-28 EP claimed